5-[4-chloranyl-3-[[1,3-dioxolan-2-ylmethyl(methyl)amino]diazenyl]phenyl]-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[4-chloranyl-3-[[1,3-dioxolan-2-ylmethyl(methyl)amino]diazenyl]phenyl]-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-[4-chloro-3-[1,3-dioxolan-2-ylmethyl(methyl)amino]azo-phenyl]-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-[4-chloro-3-[1,3-dioxolan-2-ylmethyl(methyl)amino]azophenyl]-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-[4-chloro-3-[[1,3-dioxolan-2-ylmethyl(methyl)amino]diazenyl]phenyl]-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-chloro-5-(2,4-diamino-6-ethyl-pyrimidin-5-yl)phenyl]azo-(1,3-dioxolan-2-ylmethyl)-methyl-amine Formula: C17H22ClN7O2 MolecularWeight: 391.85528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)N=NN(C)CC3OCCO3

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)N=NN(C)CC3OCCO3

InChI

InChI=1S/C17H22ClN7O2/c1-3-12-15(16(19)22-17(20)21-12)10-4-5-11(18)13(8-10)23-24-25(2)9-14-26-6-7-27-14/h4-5,8,14H,3,6-7,9H2,1-2H3,(H4,19,20,21,22)